Geometry & MOs

Info

ID:	247519
PubChem CID:	103072055
Reduced:	N3C11H19 (1)
Stoich.:	A3B11C19 (1)
Weight, g/mol:	235.204848
ΔH_f, kcal/mol:	30.23
Dipole, Da:	3.23
IP(EA), eV:	-8.62(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(3,4,5-trimethylpyrazol-1-yl)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C)CC(=C)CNC)C

DOS

IR

Vibrations